3F7L
X-ray Crystal Structure of Alvinella pompejana Cu,Zn Superoxide Dismutase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 12.3.1 |
| Synchrotron site | ALS |
| Beamline | 12.3.1 |
| Temperature [K] | 90 |
| Detector technology | CCD |
| Collection date | 2005-03-14 |
| Detector | ADSC QUANTUM 315 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 62.493, 62.493, 163.191 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 45.000 - 0.990 |
| R-factor | 0.112 |
| R-free | 0.13800 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1pu0 |
| RMSD bond length | 0.018 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | AMoRE |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.030 |
| High resolution limit [Å] | 0.990 | 0.990 |
| Number of reflections | 98085 | |
| <I/σ(I)> | 15.45 | 2.503 |
| Completeness [%] | 93.2 | 54 |
| Redundancy | 4.7 | 1.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.5 | 298 | 55% saturated ammonium sulfate, 100 mM Na citrate, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
